4-[2-[(6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)carbonylamino]ethyl]benzoic acid

Systemtic Name: 4-[2-[(6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)carbonylamino]ethyl]benzoic acid Openeye Name: 4-[2-[(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)amino]ethyl]benzoic acid CAS Name: 4-[2-[[oxo-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)methyl]amino]ethyl]benzoic acid IUPAC Name: 4-[2-[(6-oxo-4,5-dihydro-1H-pyridazine-3-carbonyl)amino]ethyl]benzoic acid Traditional Name: 4-[2-[(6-keto-4,5-dihydro-1H-pyridazine-3-carbonyl)amino]ethyl]benzoic acid Formula: C14H15N3O4 MolecularWeight: 289.2866

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NN=C1C(=O)NCCC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C1CC(=O)NN=C1C(=O)NCCC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C14H15N3O4/c18-12-6-5-11(16-17-12)13(19)15-8-7-9-1-3-10(4-2-9)14(20)21/h1-4H,5-8H2,(H,15,19)(H,17,18)(H,20,21)